CHEMBRIDGE-ZINC00457896 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.4940 1.4550 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -0.0260 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.6730 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.1620 1.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4060 -2.3440 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.7860 -0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.0060 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -2.5120 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -0.6940 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.8610 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -3.3020 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -3.9140 3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -3.9690 3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -3.2110 1.6890 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -4.7380 3.9260 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 0.0160 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 1.2280 2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.6700 3.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.0900 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 2.0010 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 1.7300 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 1.7060 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -3.7350 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.1880 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -3.1910 3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -4.3170 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.5820 5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.7960 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 0.6370 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 M END